SCHEMBL17905148

SCHEMBL17905148

COc1cc(O[C@H](C2CC2)[C@H](C)OC(=O)[C@H](C)N)ccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 1/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ SLC6A3 Q01959 2/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ CHRM5 P08912 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ FFAR4 Q5NUL3 1/20 0.33
▸ AKR1C3 P42330 1/20 0.33
▸ AKR1C2 P52895 1/20 0.33
▸ XIAP P98170 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17905500 0.81 KDM4E (0.39) HTR2AMAPTALDH1A1HPGD
SCHEMBL17905150 0.80 GRIN2D (0.38) HTR2ASMN1; SMN2NPC1RAB9AMAPT
SCHEMBL17905562 0.80 OGG1 (0.46) SLC6A3HPGD
SCHEMBL17905622 0.79 SMN1; SMN2 (0.40) HTR2ASMN1; SMN2NPC1RAB9AHPGD
SCHEMBL17905531 0.78 ACACB (0.37) HTR2ASMN1; SMN2NPC1RAB9AMAPT
SCHEMBL17905574 0.78 RORC (0.36) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL17905566 0.77 TAS1R3 (0.39) HTR2ARAB9AMAPTALDH1A1LMNA
SCHEMBL17905124 0.77 AAK1 (0.40) HTR2ASMN1; SMN2MAPTSLC6A3ALDH1A1
SCHEMBL17905674 0.77 GRM4 (0.35) HTR2ASMN1; SMN2NPC1RAB9AMAPT
SCHEMBL17905621 0.76 OGG1 (0.44) —

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3240413-B1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2020-05-13 — — EP disclosed
US-10433555-B2 Picolinamide compounds with fungicidal activity DOW AGROSCIENCES LLC (US) 2019-10-08 — — US disclosed
WO-2016109288-A1 USE OF PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2016-07-07 — — WO disclosed
WO-2016109289-A1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2016-07-07 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10433555-B2 Picolinamide compounds with fungicidal activity PFAS, CASP2, CYP1A2 HTR2A 2259/4885SMN1; SMN2 2463/4885NPC1 1093/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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